ChemSpider 2D Image | Methyl 3,4-diamino-2-methoxybenzoate | C9H12N2O3

Methyl 3,4-diamino-2-methoxybenzoate

  • Molecular FormulaC9H12N2O3
  • Average mass196.203 Da
  • Monoisotopic mass196.084793 Da
  • ChemSpider ID24197559

More details:

Validated by Experts, Validated by Users, Non-Validated, Removed by Users

3,4-Diamino-2-méthoxybenzoate de méthyle [French] [ACD/IUPAC Name]
538372-37-1 [RN]
Benzoic acid, 3,4-diamino-2-methoxy-, methyl ester [ACD/Index Name]
Methyl 3,4-diamino-2-methoxybenzoate [ACD/IUPAC Name]
Methyl-3,4-diamino-2-methoxybenzoat [German] [ACD/IUPAC Name]
3,4-DIAMINO-2-METHOXY-BENZOIC ACID METHYL ESTER
BENZOIC ACID, 3,4-DIAMINO-2-METHOXY-, METHYL ESTER (9CI)
DS-7266
methyl 3,4-diamino-2-methoxybenzoate???ws204068???
methyl-3,4-diamino-2-methoxybenzoate
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    Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module, version: 14.00

    Density: 1.3±0.1 g/cm3
    Boiling Point: 408.6±40.0 °C at 760 mmHg
    Vapour Pressure: 0.0±1.0 mmHg at 25°C
    Enthalpy of Vaporization: 66.1±3.0 kJ/mol
    Flash Point: 232.6±23.7 °C
    Index of Refraction: 1.598
    Molar Refractivity: 53.2±0.3 cm3
    #H bond acceptors: 5
    #H bond donors: 4
    #Freely Rotating Bonds: 3
    #Rule of 5 Violations: 0
    ACD/LogP: 0.70
    ACD/LogD (pH 5.5): 0.75
    ACD/BCF (pH 5.5): 2.18
    ACD/KOC (pH 5.5): 60.66
    ACD/LogD (pH 7.4): 0.75
    ACD/BCF (pH 7.4): 2.18
    ACD/KOC (pH 7.4): 60.84
    Polar Surface Area: 88 Å2
    Polarizability: 21.1±0.5 10-24cm3
    Surface Tension: 52.9±3.0 dyne/cm
    Molar Volume: 155.9±3.0 cm3

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